Vitas-M small molecule compound
methyl 4-{(Z)-[2-({[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Catalog ID
STK105035
SMILES COC(=O)c1ccc(cc1)/C=N\NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H31N5O3S MW 541.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N5O3S/c1-20-6-16-25(17-7-20)35-27(22-12-14-24(15-13-22)30(2,3)4)33-34-29(35)39-19-26(36)32-31-18-21-8-10-23(11-9-21)28(37)38-5/h6-18H,19H2,1-5H3,(H,32,36)/b31-18-InChIKey
VOAINIHVEXCRSP-MNBJERMJSA-NSynonyms
(E)methyl4((2(2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)acetyl)hydrazono)methyl)benzoate
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=C(C=C3)C(=O)OC)C4=CC=C(C=C4)C(C)(C)C
COC(=O)c1ccc(cc1)C=NNC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C
InChI=1SC30H31N5O3Sc12061625(17720)3527(22121424(151322)30(23)4)333429(35)391926(36)3231182181023(11921)28(37)385h618H19H215H3(H3236)b3118
METHYL4((Z)((2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
METHYL4((Z)(2(((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
MFCD03219975
ZINC000097959530
ZINC01824282
ZINC1824282
Check stock
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Check stock on Vitas-MAvailable files
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